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ScientificNameLabel
1,7-di-epi-beta-Cedrene
PHCD compound ID : 342
Chemical Names :
1,7-di-epi-beta-Cedrene
Molecular Formula : C15H24
Molecular Weight : 204.187801
More Details :
Names & Synonyms:
Smiles: C=C1CC[C@]23C[C@H]1C(C)(C)[C@H]2CC[C@H]3C
InChi : InChI=1S/C15H24/c1-10-7-8-15-9-12(10)14(3,4)13(15)6-5-11(15)2/h11-13H,1,5-9H2,2-4H3/t11-,12-,13-,15-/m1/s1
InChi Key : InChIKey=DYLPEFGBWGEFBB-RGCMKSIDSA-N
PubChem ID : 6431123
Rotatable bond count : 0 Rule of five : 1
Hydrogen bond acceptor count : 0 Ionization potential : 9.507632
Hydrogen bond donor count : 0 Electric dipole moment : 0.878
XLogP : 6.642 VDW volume : 228.290393
Molecular weight : 204.187801 HOMO-LUMO gap : 10.849000
Herb list :
Refrences & Litretures:
  
20.      Journal:'CHEMIJA'      Year:'2004'      Volume:'15'      Page:'64'      DOI:''      Title:'Chemical composition of essential oils of Artemisia absinthium L. (wormwood) growing wild in Vilnius'
28.      Journal:'Journal of Essential Oil Research'      Year:'2008'      Volume:'20'      Page:'390'      DOI:''      Title:'Comparison of Volatile Constituents of Acorus calamus and Asarum europaeum Obtained by Different Techniques'
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